3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide

C14H12N4O — CID 47090674

IUPAC3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
SMILESCc1nnc2ccc(C(=O)Nc3ccccc3)cn12
InChIInChI=1S/C14H12N4O/c1-10-16-17-13-8-7-11(9-18(10)13)14(19)15-12-5-3-2-4-6-12/h2-9H,1H3,(H,15,19)
InChIKeyBQSXFQLUYHMWAB-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.29
Rot. Bonds2

About 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide

3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide (PubChem CID 47090674) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
PubChem CID47090674
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
SMILESCc1nnc2ccc(C(=O)Nc3ccccc3)cn12
InChIInChI=1S/C14H12N4O/c1-10-16-17-13-8-7-11(9-18(10)13)14(19)15-12-5-3-2-4-6-12/h2-9H,1H3,(H,15,19)
InChIKeyBQSXFQLUYHMWAB-UHFFFAOYSA-N
XLogP2.29
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-fluorophenyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 53006783
N-(3,5-dimethoxyphenyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 50784686
N-(3,5-difluoro-4-iodophenyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 86880713
N-(3-chloro-4-fluorophenyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 50743657
N-[2-(2-chlorophenoxy)phenyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 51130536
(2S)-3-methyl-2-[(3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)amino]butanoic acid
CID 119359358
N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 109387957
N-(3-ethyl-2-hydroxypentyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 111115737
3-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 53157931
N-(2-ethyl-2-hydroxybutyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 111483300
1-benzyl-3-(3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)urea
CID 53014321
1-(3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidine-4-carboxylic acid
CID 84614360

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide?
The IUPAC name of 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide (CID 47090674) is 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide.
What is the SMILES notation for 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide?
The canonical SMILES for 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide is Cc1nnc2ccc(C(=O)Nc3ccccc3)cn12.
What is the InChIKey of 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide?
The InChIKey is BQSXFQLUYHMWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-10-16-17-13-8-7-11(9-18(10)13)14(19)15-12-5-3-2-4-6-12/h2-9H,1H3,(H,15,19).
What are the key properties of 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide?
3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide has a molecular weight of 252.28 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide is sourced from PubChem (CID 47090674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).